Bromide

Bromide

SCHEMBL7744559

Br.CCC(C)N1CCC(n2nc(-c3cc(Cl)c(N)cc3OC)oc2=O)C1

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4

The experimentally established mechanism targets of Bromide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 1/20 0.35
HTR4 Q13639 6/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6961630 0.99 HTR4 (0.36) HTR4ACHE
Bromide SCHEMBL7744560 0.83 HTR4 (0.46) HTR4ACHE
SCHEMBL6961633 0.82 HTR4 (0.47) HTR4ACHE
SCHEMBL8305104 0.82 HTR4 (0.44) HTR4
Hydrochloric Acid SCHEMBL8368070 0.81 HTR4 (0.43) HTR4
Bromide SCHEMBL8366387 0.80 HTR4 (0.43) HTR4ACHE
SCHEMBL7804908 0.80 HTR4 (0.48) HTR4
SCHEMBL8304880 0.78 HTR4 (0.44) HTR4ACHE
Bromide SCHEMBL7937589 0.78 HTR4 (0.45) HTR4
SCHEMBL8309549 0.78 ACHE (0.51) HTR4ACHE

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6248757-B1 ANTISEROTONINE AGENTS SANOFI-SYNTHELABO (FR) 2001-06-19 US disclosed